| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: 4-[(1R,2S)-2-amino-1-(4-chlorophenyl)butoxy]benzonitrile 4-[(1R,2S)-2-amino-1-(4-chloroph…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.75 | 8.28 | -56.04 | 3 | 3 | 1 | 61 | 301.797 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 7.65 | -5.63 | 2 | 3 | 0 | 59 | 300.789 | 5 | ↓ |
